| SpectraBase Spectrum ID |
DqISSWEpMrg |
| Name |
acetic acid, [[5-[(cyanomethyl)thio]-2-oxo-1,3-dithiol-4-yl]thio]-,methyl ester |
| Copyright |
Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
292.930877782 u |
| Formula |
C8H7NO3S4 |
| InChI |
InChI=1S/C8H7NO3S4/c1-12-5(10)4-14-7-6(13-3-2-9)15-8(11)16-7/h3-4H2,1H3 |
| InChIKey |
QZUJBCXLHHFBPY-UHFFFAOYSA-N |
| Molecular Weight |
293.388 g/mol |
| NMR Offset |
18.0059 |
| NMR Spectrometer Frequency |
300.135 |
| Observed nucleus |
1H |
| Sample State |
Soluted |
| Sample_ID |
1H_CB_2017_1964 |
| Solvent |
DMSO-d6 |
| Source |
Vendor ID: ZI/7115589; Lab Info: KH; Lab Number: KH-0000152 |
| Temperature |
29.85 °C |
![acetic acid, [[5-[(cyanomethyl)thio]-2-oxo-1,3-dithiol-4-yl]thio]-,methyl ester](/api/spectrum/DqISSWEpMrg/structure.png?h=300&w=458 "acetic acid, [[5-[(cyanomethyl)thio]-2-oxo-1,3-dithiol-4-yl]thio]-,methyl ester")
